Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.55 |
| ▸ | RAB9A | P51151 | 8/20 | 0.55 |
| ▸ | NPC1 | O15118 | 7/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.55 |
| ▸ | RELA | Q04206 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | STAT3 | P40763 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | CASP3 | P42574 | 2/20 | 0.47 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.47 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.47 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | RARB | P10826 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9560986 | 1.00 | SMN1; SMN2 (0.55) | SMN1; SMN2RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL9560916 | 0.99 | SMN1; SMN2 (0.56) | SMN1; SMN2RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL9561003 | 0.96 | SMN1; SMN2 (0.53) | SMN1; SMN2RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL9560330 | 0.96 | SMN1; SMN2 (0.53) | SMN1; SMN2RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL9560531 | 0.96 | SMN1; SMN2 (0.53) | SMN1; SMN2RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL9560731 | 0.96 | SMN1; SMN2 (0.53) | SMN1; SMN2RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL9560577 | 0.96 | SMN1; SMN2 (0.53) | SMN1; SMN2RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL9560282 | 0.96 | SMN1; SMN2 (0.53) | SMN1; SMN2RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL9560296 | 0.95 | SMN1; SMN2 (0.54) | SMN1; SMN2RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL9560978 | 0.95 | SMN1; SMN2 (0.54) | SMN1; SMN2RAB9ANPC1NFKB1NFKB2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5190688-A | Perfluoroalkyl Compounds Dopes | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-03-02 | — | — | US | disclosed |
| EP-0300009-B1 | LIQUID CRYSTALLINE MIXTURE | MERCK PATENT GmbH (DE) | 1992-01-02 | — | — | EP | disclosed |